General Information of the Compound
| Compound ID |
CP0570837
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| Compound Name |
N-[6-[4-[(2S)-1,1,1-trifluoropropan-2-yl]-1,2,4-triazol-3-yl]pyridin-2-yl]quinoxaline-5-carboxamide
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| Formula |
C19H14F3N7O
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| Molecular Weight |
413.363
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| Canonical SMILES |
C[C@H](n1cnnc1-c1cccc(NC(=O)c2cccc3nccnc23)n1)C(F)(F)F
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| InChI |
InChI=1S/C19H14F3N7O/c1-11(19(20,21)22)29-10-25-28-17(29)14-6-3-7-15(26-14)27-18(30)12-4-2-5-13-16(12)24-9-8-23-13/h2-11H,1H3,(H,26,27,30)/t11-/m0/s1
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| InChIKey |
LKOPVGNIFBUBBW-NSHDSACASA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound